# Fileset [polymlp.yaml.xz](https://mdr.nims.go.jp/filesets/df3c69bb-a0af-4974-87b5-cf2ecc610957/download) ## Creator [Atsushi Togo](https://orcid.org/0000-0001-8393-9766) ## Rights Creative Commons Attribution 4.0 International[Creative Commons BY Attribution 4.0 International](https://creativecommons.org/licenses/by/4.0/) ## Other metadata [First-principles lattice thermal conductivity calculation for AgCl / P2_1/m (11) / materials id 570687](https://mdr.nims.go.jp/datasets/e4b2eda9-f489-42e4-92d9-6c13b09c407a) ## Fulltext elements: [Ag, Cl]cutoff: 8.0pair_type: gaussianfeature_type: gtinvmodel_type: 3max_p: 2max_l: 8gtinv_order: 3gtinv_maxl: [8, 8]gtinv_sym: [0, 0]gtinv_version: 1electrostatic: 0mass: [107.9, 35.45]n_pair_params: 11pair_params:- [1.0, 0.0]- [1.0, 0.7777777777777778]- [1.0, 1.5555555555555556]- [1.0, 2.3333333333333335]- [1.0, 3.111111111111111]- [1.0, 3.888888888888889]- [1.0, 4.666666666666667]- [1.0, 5.444444444444445]- [1.0, 6.222222222222222]- [1.0, 7.0]- [0.0, 0.0]n_type_pairs: 3type_pairs:- atom_type_pair: [0, 0] pair_params_indices: [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10]- atom_type_pair: [0, 1] pair_params_indices: [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10]- atom_type_pair: [1, 1] pair_params_indices: [0, 1, 2, 3, 4, 5, 6, 7, 8, 9, 10]type_full: 1type_indices: [0, 1]n_coeffs: 8283coeffs: [-4.370911198603946e-01, 6.783094888674405e+00, 3.791865702931433e+02, 1.091122492514786e+04, 6.757150914955838e+04, -5.462132480768443e+02, 6.606052450834817e+06, 0.000000000000000e+00, 5.111553160816243e+04, 9.175942138770169e+04, 3.102558002816470e+03, -1.769491205263932e+07, 0.000000000000000e+00, 1.889761561483098e+05, -1.438350586290820e+05, -2.205936139257588e+03, -1.347974691623814e+07, 0.000000000000000e+00, -9.065796676523317e+04, -2.492707476297629e+04, -4.945237394036496e+03, -4.728282602654224e+06, 0.000000000000000e+00, 1.543494872999468e+04, 2.079636773691441e+05, -5.911136919427655e+02, -4.318911807769875e+06, 0.000000000000000e+00, 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